Exact Mass: 216.097

Benzo[c]fluorene

7H-Benzo[c]fluorene

2-METHYLFLUORANTHENE

3-METHYLFLUORANTHENE

gamma-Glutamyl-gamma-aminobutyraldehyde

γ-Glutamyl-γ-aminobutyraldehyde

An L-glutamine derivative that is L-glutamine in which a hydrogen attached to the amide nitrogen is replaced by a 4-oxobutyl group.

Benzo[b]fluorene

11h-benzo(b)fluorene

L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid

1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid, (S)-isomer

L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is found in garden tomato (var.). L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages. L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is formed by Pictet-Spengler condensation of L-tryptophan and formaldehyde in nature or during food processin Widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages. Formed by Pictet-Spengler condensation of L-tryptophan and formaldehyde in nature or during food processing. L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is found in garden tomato (variety).

3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal

(2E)-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-enal

3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal is found in citrus. 3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal is produced by injured peel of grapefruit (Citrus paradisi) and orange (Citrus sinensis). Production by injured peel of grapefruit (Citrus paradisi) and orange (Citrus sinensis). 3-[4-Hydroxy-3-(3-methyl-2-butenyl)phenyl]-2-propenal is found in citrus.

Prolyl-Threonine

3-Hydroxy-2-{[hydroxy(pyrrolidin-2-yl)methylidene]amino}butanoate

Prolyl-Threonine is a dipeptide composed of proline and threonine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

Threonylproline

(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

Threonylproline is a dipeptide composed of threonine and proline. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

Sakacin P

tert-butyl N-(1-carbamoyl-1-oxopropan-2-yl)carbamate

Sakacin P is found in animal foods. Sakacin P is produced by Lactobacillus sake LTH 673 isolated from fermented dry sausage. Production by Lactobacillus sake LTH 673 isolated from fermented dry sausage. Sakacin P is found in animal foods. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D001430 - Bacteriocins

N2,N5-Diacetylornithine

(2S)-2,5-diacetamidopentanoic acid

N2,N5-Diacetylornithine, also known as bisorcic, belongs to the class of organic compounds known as N-acyl-L-alpha-amino acids. These are N-acylated alpha amino acids which have the L-configuration of the alpha-carbon atom. N2,N5-Diacetylornithine is an N-acetyl-L-amino acid that is L-ornithine carrying two acetyl substituents at positions N-2 and N-5. N2,N5-Diacetylornithine was identified as one of forty plasma metabolites that could be used to predict gut microbiome Shannon diversity (PMID: 31477923). Shannon diversity is a metric that summarizes both species abundance and evenness, and it has been suggested as a marker for microbiome health. C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

2,5-Bis(acetylamino)pentanoic acid

2,5-Bis[(1-hydroxyethylidene)amino]pentanoate

1-Methylpyrene

1-METHYLPYRENE

7-Methoxy-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one

7-Methoxydeoxyvasicinone

2,3-Dihydro-7-methoxypyrrolo(2,1-b)quinazolin-9(1H)-one

[(2S,3R)-2-Amino-3-hydroxybutanoyl] (2S)-pyrrolidine-2-carboxylate

[(2S,3R)-2-Amino-3-hydroxybutanoyl] (2S)-pyrrolidine-2-carboxylic acid

Tazolol

1-[(propan-2-yl)amino]-3-(1,3-thiazol-2-yloxy)propan-2-ol

C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist

Trimethylolmelamine

({4,6-bis[(hydroxymethyl)amino]-1,3,5-triazin-2-yl}amino)methanol

C6H12N6O3 (216.0971)

Isoketocamphoric acid

3-(2-methyl-3-oxobutan-2-yl)pentanedioic acid

Isoketocamphoric acid, also known as isoketocamphate, is a member of the class of compounds known as medium-chain fatty acids. Medium-chain fatty acids are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. Isoketocamphoric acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Isoketocamphoric acid can be found in common sage, which makes isoketocamphoric acid a potential biomarker for the consumption of this food product.

A member of the class of isoquinolines that is 5,8-dihydroisoquinoline substituted by methyl, methyl, oxo, methylamino and oxo groups at positions 3, 4, 5, 7 and 8, respectively. It was isolated from Streptomyces Sp. strain Mei37 from North Sea coast, Germany.

Liguhodgsonal

(R)-5,6,7,8-Tetrahydro-3-hydroxy-7-(1-methylethenyl)-1-naphthalenecarboxaldehyde

Botryolide D

8-Norlactaranelactone

Decarestrictine D

4-Methoxy-6-vinyl-2,3-dimethylchromene

Ophiocerin D

SCHEMBL16343966

N-Acetyl-beta-oxotryptamine

Colpuchol

damirone A

Mysorenone B

Diethyl 2-acetylsuccinate

{[[(4-Cyanobenzyl)amino](imino)methyl]amino}methanimidamide

C10H12N6 (216.1123)

4-antipyrinecarboxaldehyde

1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde

3-Ethyl-4-(methoxyamino)-2,5-dioxoimidazolidine-4-carboxamide

C7H12N4O4 (216.0859)

2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11ah)-dione

NCGC00381387-02

4,6,12-Tetradecatriene-8,10-diyne-1,3-diol

5-hydroxy-2,5,7-trimethylspiro[cyclopropane-1,6-indene]-4-one

SCHEMBL17581885

3-hydroxy-7-prop-1-en-2-yl-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde

(2E,8E)-9-(tetrahydro-2H-pyran-2-yl)nona-2,8-diene-4,6-diyn-1-ol|(E,E)-form-9-(Tetrahydropyran-2-yl)-2,8-nonadiene-4,6-diyn-1-ol|9t-(Tetrahydro-pyran-2-yl)-nona-2t,8-dien-4,6-diin-1-ol

Harmalacidine

Precolpuchol

9-(Tetrahydro-2H-pyran-2-yl)-1,8-nonadiene-4,6-diyn-3-ol,|9-(Tetrahydropyran-2-yl)-nona-trans-1,8-dien-4,6-diin-3-ol

?-Methoxy-3-(tetrahydro-5-methoxy-4-methyl-3-furanyl)-2-propenoic acid

7E,11E-tetradecadiene-5,9-diynoic acid

Tsugicoline I

7a-hydroxygelsemiol

DTXSID40555943

Decarestrictine O

C14H16O2

DTXSID80388373

3-methyl-3-buten-1-yl cinnamate

Syneilesinolide A

DTXSID20388372

SCHEMBL2109666

Buergerinin E

(2R,3R,5E)-5-Ethylidene-2-hydroxy-2,3-dimethylhexanedioic acid|5-Ethylidene-2-hydroxy-2,3-dimethylhexanedioic acid

1,3-dihydroxy-6(E)-tetradecene-8,10,12-triyne

2,8,10-Tetradecatriene-4,6-diyne-1,14-diol|Tetradeca-2t,8t,10t-trien-4,6-diin-1,14-diol|tetradeca-2t,8t,10t-triene-4,6-diyne-1,14-diol|Tetradecatrien-(2t,8t,10t)-diin-(4,6)-diol-(1,14)

Lamiolgenin

ACMC-20n3nv

podoandin

(E)-form-6-Tetradecene-8,10,12-triyne-1,5-diol,

tetradeca-4E,12E-diene-cis-8,10-epoxide-1-ol

6-Vinyl-7-methoxy-2,2-dimethylchromene

Decarestrictine G

DTXSID40823735

2-METHYLPYRENE

Caerulomycin F

A pyridine alkaloid that is 2,2-bipyridine substituted at position 6 by a hydroxymethyl group and at position 4 by a methoxy group. Isolated from the marine-derived actinomycete Actinoalloteichus cyanogriseus, it exhibits antineoplastic activity.

Curzerenone

(6E,12E)-3-oxo-tetradeca-6,12-dien-8,10-diyn-1-ol

7-(chloromethylidene)dec-4-enoic acid

C11H17ClO2 (216.0917)

SCHEMBL10641597

(2-aminophenyl)(2-ethyloxazol-5-yl)methanone

(2R,5S,7S)-3alpha-hydroxyexogonic acid

3-(Hydroxymethyl)-4-[1-(hydroxymethyl)-2-hydroxypropyl]-5,6-dihydro-2H-pyran-2-one

1,2,3,4-Tetrahydro-5-methoxy-1-oxo-beta-carboline|5-Methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carbolin|5-methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carboline|5-methoxy-1-oxo-tetrahydro-beta-carboline|5-Methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-on|5-methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-one

1,2,3,4-Tetrahydro-5-methoxy-1-oxo-beta-carboline|5-Methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carbolin|5-methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carboline|5-methoxy-1-oxo-tetrahydro-beta-carboline|5-Methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-on|5-methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-one

(S)-Ligujapone|Ligujapon

1-METHYLPYRENE

cis-nemorensic acid|cis-Nemorensin-saeure

decarestrictine M

3,6-epoxydecanedioic acid

2,6-Diamino-7-hydroxyazelainsaeure

1,2,3,9-tetrahydropyrrolo(2,1-b)quinazolin-1-carboxylic acid

(R)-2,2-Dimethyl-3-(3-oxo-butyl)-bernsteinsaeure und cyclische Tautomere|(R)-2,2-dimethyl-3-(3-oxo-butyl)-succinic acid and cyclic tautomer(ic)

SCHEMBL9095227

5,6,7,8-tetrahydro-6-hydroxy-7-(1-methylethenyl)-naphthalene-1-carboxaldehyde|8beta-hydroxy-2-dehydroxyliguhodgsonal

4-METHYLPYRENE

2-Methyl-4-oxoglutaric acid diethyl ester

prenyl cinnamate

2,3-Benzofluorene

11h-benzo(b)fluorene

7-Phenyl-4,6-heptadiyne-1,2,3-triol

C10H16O5

(E)-Cinnamyl 2-methylisocrotonate

Isoketocamphoric acid

(2E,4E,6E,8E,10E)-4,9-dimethyldodeca-2,4,6,8,10-pentaenedial

4-Formyl-antipyrine

1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde

CONFIDENCE standard compound; INTERNAL_ID 2667 CONFIDENCE standard compound; INTERNAL_ID 4107

1,2,3,4-Tetrahydro-6-Methoxy-1-oxo-beta-carboline

"NCGC00160221-01!1,2,3,4-Tetrahydro-6-Methoxy-1-oxo-beta-carboline"

2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione

"NCGC00160211-01!2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione"

C10H16O5_(4S,5S,6E,8S,10R)-4,5,8-Trihydroxy-10-methyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one

NCGC00380632-01_C10H16O5_(4S,5S,6E,8S,10R)-4,5,8-Trihydroxy-10-methyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one

Carboline base + 4H, carboxylic acid

Annotation level-3

cycloanthranilylproline

Organic chemicals, Polycyclic compounds, Anthracenes

lycoperodine I

Origin: Plant, Pyrans

Cymoxanil-TP IN-KQ960

3-Ethyl-4-(methoxyamino)-2,5-dioxoimidazolidine-4-carboxamide

C7H12N4O4 (216.0859)

CONFIDENCE standard compound; UCHEM_ID 4210

2-Naphthalenepropanol, 6-hydroxy-a-methyl-

Captopril

C10H16O3S (216.082)

Thr Pro

Pro Thr

desethyletomidate

10E,12E-tetradecadiene-4,6-diynoic acid

10,12-Tetradecadiene-4,6-diynoic acid, (E,E)-

Naproxol

(S)-2-(6-methoxynaphthalen-2-yl)propan-1-ol

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

Pro-THR

1-(2-amino-3-hydroxybutanoyl)pyrrolidine-2-carboxylic acid

THR-Pro

3-hydroxy-2-(pyrrolidin-2-ylformamido)butanoic acid

A dipeptide formed from L-threonine and L-proline residues.

Cyclomethyltryptophan

L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid

Sakacin P

tert-butyl N-(1-carbamoyl-1-oxopropan-2-yl)carbamate

D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D001430 - Bacteriocins

4-Hydroxy-3-prenylcinnamaldehyde

(2E)-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-enal

Tuckolide

Decarestrictine D

FA 14:6

(2E,4E)-tetra-deca-2,4-diene-8,10-diynoic acid

4-(6-AMINO-2-PYRIDINYL)-3-METHOXYPHENOL

3-(6-METHYL-2H-1 4-BENZOXAZIN-3(4H)-ONE&

ETHYL 2-(1H-PYRAZOL-1-YL)BENZOATE

6-tert-butyl-4-methylcoumarin

(S)-4-((1H-INDOL-3-YL)METHYL)OXAZOLIDIN-2-ONE

4-AMINO-N-FURAN-2-YL-METHYLBENZAMIDE

3-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]-3-OXO-PROPIONICACID

2,2-Bipyridine-4,4-diyldimethanol

potassium dodecahydrododecaborate hydrate

B10H12K2O (216.1093)

Hydantoin, 1,3-bis(2-hydroxyethyl)-5,5-dimethyl-

2-(2-OXO-2-PHENYL-ETHYL)-CYCLOHEXANONE

6-FLUORO-3-(1,2,3,6-TETRAHYDRO-PYRIDIN-4-YL)-1H-INDOLE

Zimidoben

4,4-Diamino-3,3-biphenyldiol

9,10-(2H8)Anthracenedione

C14D8O2 (216.1026)

1-BENZYL-1H-PYRAZOLE-4-CARBOXYLIC ACID METHYL ESTER

2-[3-(1H-IMIDAZOL-1-YL)PHENYL]-1,3-DIOXOLANE

4-(3,5-dimethyl-pyrazol-1-yl)-benzoic acid

5-methyl-2-(2-methylphenyl)-1H-imidazole-4-carboxylic acid

3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxylic acid

n-(2-fluorophenyl)piperazine hydrochloride

C10H14ClFN2 (216.0829)

3-Methoxy-4-(4-methyl-1H-imidazol-1-yl)benzaldehyde

2-(3-FORMYL-2-METHYL-INDOL-1-YL)-ACETAMIDE

5-CYANOINDOLE-3-CARBOXALDEHYDE

(S)-(+)-2,3-DIHYDRO-1H-PYRROLO[2,1-C][1,4]BENZODIAZEPINE-5,11(10H,11AH)-DIONE

6-Methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one

2,3,4,9-tetrahydro-6-methoxy-1H-pyrido[3,4-b]indol-1-one

4-(1,8-MAPHTHYRIDIN-2-YL)BUTANOIC ACID

1,3-Bis(4,5-dihydro-2-oxazolyl)benzene

Ethyl 4-phenyl-1H-pyrazole-3-carboxylate

Cyclazodone

ethyl 6-methylquinazoline-2-carboxylate

(S)-4-(2-METHYLBUTYL)[1,1-BIPHENYL]-4-CARBONITRILE

dimethyl 5-hydroxycyclohexane-1,3-dicarboxylate

Ethyl acetylsuccinate

1,4,7-trioxacyclotridecane-8,13-dione

3-Nitro-pyrrolidine-1-carboxylic acid tert-butyl ester

ethyl 1-phenylpyrazole-4-carboxylate

3-Cyano-4-(5,5-Dimethyl-[1,3,2]Dioxaborinan-2-Yl)-Pyridine

1-(4-METHOXYPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE

5-methyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid

Diethyl ethoxymethylenemalonate

Sodium 1-octanesulfonate

C8H17NaO3S (216.0796)

5-methyl-1-p-tolyl-1h-pyrazole-3-carboxylic acid

DIETHYL1,4-DIHYDRO-2,6-DIMETHYL-1,4-DIPHENYL-3,5-PYRIDINEDICARBOXYLATE

C10H16O5-- (216.0998)

Tetrantoin

1,3-DIMETHYL-5-PHENOXY-1H-PYRAZOLE-4-CARBALDEHYDE

5-FLUORO-3-(1,2,3,6-TETRAHYDRO-PYRIDIN-4-YL)-1H-INDOLE

[3-(6-methylpyrazin-2-yl)oxyphenyl]methanol

Trimethylolmelamine

Methanol,1,1,1-(1,3,5-triazine-2,4,6-triyltriimino)tris-

C6H12N6O3 (216.0971)

2,3,4,9-Tetrahydro-1H-beta-carboline-3-carboxylic acid

1H-Pyrido[3,4-b]indole-3-carboxylicacid, 2,3,4,9-tetrahydro-, (3R)-

METHYL 5-(P-TOLYL)-1H-PYRAZOLE-4-CARBOXYLATE

7-fluoro-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole

4-fluoro-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole

2-(PYRIDIN-3-YL)-5-(PYRROLIDIN-2-YL)-1,3,4-OXADIAZOLE

ethyl 2-(2-oxocyclohexyl)sulfanylacetate

C10H16O3S (216.082)

diethyl 2-methyl-3-oxopentanedioate

6-Ethoxy-2-naphthaleneboronic acid

C12H13BO3 (216.0958)

1-(4-NITROPHENYL)CYCLOPENTANECARBONITRILE

3,3,6,8-TETRAMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENE-1,2-DIONE

Diethyl 3-oxoadipate

METHYL 3-(1H-PYRAZOL-1-YLMETHYL)BENZOATE

3-(3-Phenyl-2-propenyl)-2,4-pentanedione

3-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID METHYL ESTER

5-Amino-1-(2-fluorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

C11H9FN4 (216.0811)

4-[(Dimethylamino)methylene]-2-phenyl-1,3-oxazol-5(4H)-one

4-[2-(1H-imidazol-1-yl)ethoxy]benzaldehyde

Benzaldehyde, 3-ethoxy-4-(1H-imidazol-1-yl)

D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid

(R)-2,3,4,9-Tetrahydro-1H-pyrido[3,4-B]indole-3-carboxylic acid

1-METHYL-5-(P-TOLYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID

[3-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl] boronic acid

Diethyl 2-(2-oxopropyl)malonate

ACETONYLMALONIC ACIDDIETHYL ESTER

(4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDIN-5-YL)METHANAMINE

3-(2-Phenyl-imidazol-1-yl)-propionic acid

2-(3,5-DIMETHYL-PYRAZOL-1-YL)-BENZOIC ACID

1,2-Ethanediol,1,2-di-4-pyridinyl-

3-(1-phenylethyl)imidazole-4-carboxylic acid

2-(2-NAPHTHYLOXY)ACETOHYDRAZIDE

4-Cyanopyridine-3-boronic acid neopentyl glycol ester

Acetonitrile,2,2,2,2-(1,2-ethanediyldinitrilo)tetrakis-

C10H12N6 (216.1123)

1-Allyl-7-Methoxy-2-tetralone

ethyl 7-aminoquinoline-3-carboxylate

2-AMINO-6-QUINOLINECARBOXYLIC ACID ETHYLESTER

Leflunomide EP Impurity G

Benzyl (1-cyanocyclopropyl)carbamate

2-Methylphenol

1-(2-Fluorphenyl)piperazinhydrochlorid

C10H14ClFN2 (216.0829)

6-(4-methoxyphenoxy)pyridin-3-amine

[4-(6-methylpyrazin-2-yl)oxyphenyl]methanol

5-Amino-1-(4-fluorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

C11H9FN4 (216.0811)

2-Quinoxalinepropanoicacid, 3-methyl-

N-(4-amino-2-methylphenyl)furan-2-carboxamide

(R)-4-((1H-INDOL-3-YL)METHYL)OXAZOLIDIN-2-ONE

Ethyl 2-(1H-imidazol-1-yl)benzoate

3-(2-OXO-2-PHENYLETHYL)-5,6-DIHYDROPYRAZIN-2(1H)-ONE

5-(Benzyloxy)-2-Methoxypyrimidine

2-AMINO-N-FURAN-2-YLMETHYL-BENZAMIDE

Ethyl 5-phenyl-1H-pyrazole-3-carboxylate

1-PHENYL-4-TRIMETHYLSILANYL-BUT-3-YN-2-ONE

C13H16OSi (216.097)

2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-1-CARBOXYLIC ACID

1,2,3,4-Tetrahydro-β-carboline-1-carboxylic acid is a chemical used on the study of neurodegenerative diseases[1].

Benzyl 3-cyano-1-azetidinecarboxylate

N-(METHYL)MERCAPTOACETAMIDE

Ethyl 2-aminoquinoline-3-carboxylate

(R)-2-AMINO-3-(QUINOLIN-2-YL)PROPANOIC ACID

(S)-2-(2-BROMOPHENYL)-4-ISOPROPYL-4,5-DIHYDROOXAZOLE

ethyl 1-phenylimidazole-4-carboxylate

Methyl 5-(p-tolyl)-1H-pyrazole-3-carboxylate

N-hydroxy-4-methoxynaphthalene-1-carboximidamide

(E)-ETHYL 3-(IMIDAZO[1,2-A]PYRIDIN-3-YL)ACRYLATE

1-Piperazinepropanol,hydrochloride (1:2)

C7H18Cl2N2O (216.0796)

bis(2-cyanoethyl)phenylphosphine

C12H13N2P (216.0816)

4-Amino-quinoline-3-carboxylic acid ethyl ester

5-PHENETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID

1-benzyl-5-methylpyrazole-3-carboxylic acid

2-amino-3-quinolin-4-ylpropanoic acid

1H-Imidazole-5-carboxylicacid, 1-(phenylmethyl)-, methyl ester

1H-Imidazole-4-carboxamide,5-amino-N-(2-methylphenyl)-(9CI)

ethylbenzothiazolylidenemethylpropenyl-&

C13H14NS (216.0847)

1H-Cyclopenta[l]phenanthrene

4-methoxy-3-(pyrazol-1-ylmethyl)benzaldehyde

3-(3,5-Dimethyl-1H-pyrazol-1-yl)benzoic acid

2,5-dimethyl-1-(4-nitrophenyl)-1h-pyrrole

1-(3-NITROPHENOXY)-2-PROPANONE

3-Imidazol-1-ylmethyl-4-methoxy-benzaldehyde

3-Quinolin-2-yl-L-alanine

Ethyl 3-phenyl-1H-pyrazole-5-carboxylate

Methyl 2-(1-hexyn-1-yl)benzoate

(1-BENZYL-1H-IMIDAZOL-2-YL)-ACETIC ACID

SPIRO[CHROMAN-2,1-CYCLOHEXAN]-4-ONE

2-methyl-2,6-diazaspiro[3.4]octane

5-METHYL-2-PHENYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER

2-Ethoxy-1-naphthaleneboronic acid

C12H13BO3 (216.0958)

ETHYL 4-(1H-PYRAZOL-1-YL)BENZOATE

6-acetamido-4-hydroxy-2-methylquinoline

(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)boronic acid

5-METHYL-2-P-TOLYL-2H-PYRAZOLE-3-CARBOXYLIC ACID

ethyl 8-aminoquinoline-3-carboxylate

Methyl 1-allyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

1,2-DI(PYRIDIN-3-YL)ETHANE-1,2-DIOL

1-(4-METHOXYBENZYL)-1H-PYRAZOLE-4-CARBALDEHYDE

Methyl 4-(1-methyl-1H-pyrazol-3-yl)benzoate

1,4-Benzenediacetonitrile,2,5-dimethoxy-

2-(3,5-Dimethyl-1H-pyrazol-4-yl)benzoic acid

diethyl 2-ethyl-3-oxobutanedioate

1-Chloro-5-triethylsilyl-4-pentyne

C11H21ClSi (216.1101)

4,4′-dimethoxy-2,2′-bipyridine

Ethyl 2-phenyl-imidazole-4-carboxylate

3-(3-FORMYL-INDOL-1-YL)-PROPIONAMIDE

4-ACETYL-4-METHYLHEPTANEDIOIC ACID

3-butoxy-6-hydroxybenzene-1,2-dicarbonitrile

3-Piperidinecarboxylic acid,1-(aminothioxomethyl)-,ethyl ester

METHYL5-METHYL-1-PHENYLPYRAZOLE-4-CARBOXYLATE

4-(morpholine-4-carbonyl)benzonitrile

4-HYDROXY-6-METHOXYMETHYL-2-PHENYLPYRIMIDINE

Ethyl 4-(1H-imidazol-1-yl)benzoate

N,N-Dimethyl-1-(morpholin-2-yl)methanamine dihydrochloride

C7H18Cl2N2O (216.0796)

N-(4-Cyanophenyl)-L-proline

3-FLUORO-3-METHYLBENZHYDROL

N,5-DIMETHYL-3-PHENYLISOXAZOLE-4-CARBOXAMIDE)

1-benzyl-5-methylimidazole-4-carboxylic acid

2-(2-hydroxyethyl)-6-phenyl-3(2H)-pyridazinone

METHYLFLUORANTHENE

1,2,3,4-tetrahydronaphthalen-1-ylidine acetatic acid ethyl ester

6-benzyloxymethyl-4-hydroxypyrimidine

METHYL 4-(1H-IMIDAZOL-1-YLMETHYL)BENZOATE

5H-Benzo[a]fluorene

Trimethylolmelamine Resin

C6H12N6O3 (216.0971)

3-(2,4-dimethylphenyl)-1H-pyrazole-4-carboxylic acid

3-(2,4-DIMETHYLPHENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID

(2-(2-methoxyphenyl)pyrimidin-4-yl)methanol

1-(1,3-Benzoxazol-2-yl)piperidin-4-one

cinnamyl tiglate

1-Cyclopentene-1-carboxylicacid,2-p-methylbenzyl-(5CI)

(s)-2-amino-3-benzyloxy-1-propanol

FURAN-2-CARBOXYLIC ACID (5-AMINO-2-METHYL-PHENYL)-AMINO

METHYL 4-(1H-PYRAZOL-1-YLMETHYL)BENZOATE

Piperazine,1-(4-fluorophenyl)-, hydrochloride (1:1)

C10H14ClFN2 (216.0829)

3-FLUORO-4-METHYLBENZHYDROL

(4-fluoro-benzyl)-pyridin-3-ylmethyl-amine

3-Phosphorincarbonitrile,4-amino-1,2,5,6-tetrahydro-1-phenyl-

C12H13N2P (216.0816)

1H-Carbazole,2,3,4,9-tetrahydro-6-nitro-

3-(4-Ethoxy-phenyl)-1H-pyrazole-4-carbaldehyde

3-AMINO-N-(3,4-DIMETHYLPHENYL)BENZAMIDE

2-Amino-5-bromonicotinaldehyde

3-(3-FLUOROPHENYL)PHENETHYL ALCOHOL

3-(4-FLUOROPHENYL)PHENETHYL ALCOHOL

2-Cyanopyridine-3-boronic acid neopentyl glycol ester

1-(naphthoxy)acetic acid hydrazide

Diethyl 3-hydroxycyclobutane-1,1-dicarboxylate

Carbamic acid, (3-isothiocyanatopropyl)-, 1,1-dimethylethyl ester (9CI)

2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-carboxylic acid

cyanoiminomethylideneazanide,4-(3-methylimidazol-3-ium-1-yl)butanenitrile

C10H12N6 (216.1123)

3-(1-PHENYL-1H-PYRAZOL-4-YL)PROPANOIC ACID

1-phenyl-1H-Imidazole-2-carboxylic acid ethyl ester

ethyl 1-phenyl-1H-pyrazole-3-carboxylate

1H-Imidazole-5-carboxylicacid,4-methyl-1-(phenylmethyl)-(9CI)

Ethyl 4-phenyl-1H-imidazole-5-carboxylate

5-(4-ETHYL-PHENYL)-2H-PYRAZOLE-3-CARBOXYLIC ACID

2-CHLORO-N-(1-METHYL-1H-PYRAZOL-4-YL)-ACETAMIDE

Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate

Methyl 3-(1-Methyl-5-imidazolyl)benzoate

1-(1H-benzimidazol-2-yl)-1,3-diazinan-2-one

4-Oxosebacic acid

1,2-Dipyridin-2-ylethane-1,2-diol

4,9-Dimethyldodeca-2,4,6,8,10-pentaenedial

6-ethyl-2,5-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

(R)-(+)-1-(1-Phenylethyl)-1H-imidazole-5-carboxylic acid

1H-Indeno[5,6-c]furan-1-one, 3,5,6,7-tetrahydro-6,6,8-trimethyl-

Prolyl-Threonine

Silane, trimethyl(2-naphthalenyloxy)-

C13H16OSi (216.097)

Silane, trimethyl(1-naphthalenyloxy)-

C13H16OSi (216.097)

Allosamizoline

N-acetyl-L-citrullinate

C8H14N3O4- (216.0984)

4-(gamma-L-glutamylamino)butanal

5-amino-1-(beta-D-ribofuranosyl)imidazol-3-ium

C8H14N3O4+ (216.0984)

[(2S,3R)-2-Amino-3-hydroxybutanoyl] (2S)-pyrrolidine-2-carboxylate

6-(4-Methoxyphenyl)pyrimidine-2,4-diamine

(2R,4S,5E,7S,8S)-4,7,8-trihydroxy-2-methyl-2,3,4,7,8,9-hexahydrooxecin-10-one

6-Hydroxy-alpha-methyl-2-naphthalenepropanol

4-methyl-3-phenyl-1H-pyrazole-5-carbohydrazide

(3-Amino-1,2,4-triazol-4-yl)-(2,5-dimethylphenyl)methanone

(Z)-3-hydroxydec-2-enedioic acid

Cyclopenta[l]phenanthrene

P,P-diphenylphosphinimidic amide

C12H13N2P (216.0816)

2-Methoxy-4-(1-methyl-4-pyridin-1-iumyl)phenol

C13H14NO2+ (216.1024)

Threoninyl-proline

3-Hydroxydecanedioate

C10H16O5-2 (216.0998)

5-Amino-1-[(4-fluorophenyl)methyl]imidazole-4-carbonitrile

C11H9FN4 (216.0811)

6-[(3S)-3-hydroxybutyl]naphthalen-2-ol

(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate

C9H14NO5- (216.0872)

2-[(Z)-hydroxyiminomethyl]-5,7-dimethylquinolin-8-ol

N-Acetyl-alanyl-alanine methyl ester

5-Nitro-2,3-dimethyl-1,7-dimethyleneindole

Dimethyl ethyl(2-oxopropyl)malonate

Benzo(a)fluorene

11H-Benzo[a]fluorene

benzo(c)fluorene

7H-Benzo[c]fluorene

gamma-glutamyl-gamma-aminobutyraldehyde zwitterion

An amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of gamma-glutamyl-gamma-aminobutyraldehyde; major species at pH 7.3.

1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid

A member of the class of beta-carbolines that is 1,2,3,4-tetrahydro-beta-carboline substituted at position 3 by a carboxy group.

3-(4-Hydroxy-3-(3-methyl-2-butenyl)phenyl)-2-propenal

Prolylthreonine

Bisorcic

N2,N5-Diacetyl-L-ornithine

C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

Anacyclic acid

3-hydroxysebacate(2-)

A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of 3-hydroxysebacic acid.

NA-Asn 5:0

NA-Gln 4:0

Cyclo(Cys-Ile)

Cyclo(Cys-Leu)

3-phenylprop-2-en-1-yl 2-methylbut-2-enoate

(4e)-7-(chloromethylidene)dec-4-enoic acid

C11H17ClO2 (216.0917)

(6r)-6-[(2r,3r)-3-phenyloxiran-2-yl]-5,6-dihydropyran-2-one

5-ethylidene-2-hydroxy-2,3-dimethylhexanedioic acid

(5r)-3-[(1s,2r)-2-hydroxy-1-methoxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one

tetradeca-4,6,12-trien-8,10-diyne-1,3-diol

(2e)-3-[4-(buta-2,3-dien-1-yloxy)phenyl]prop-2-enoic acid

(6r)-6-[(2s,3r)-3-phenyloxiran-2-yl]-5,6-dihydropyran-2-one

6-methoxy-2h,3h,4h,9h-pyrido[3,4-b]indol-1-one

7-methoxy-2h,3h,4h,9h-pyrido[3,4-b]indol-1-one

(4r,5s,10r)-4,5-dihydroxy-10-methyloxecane-2,7-dione

(7s,9as)-7,9a-dimethyl-3-oxo-8,9-dihydro-7h-benzo[7]annulene-6-carbaldehyde

8-hydroxy-3,9-diazatricyclo[8.4.0.0³,⁷]tetradeca-1(14),8,10,12-tetraen-2-one

3-methyl-5-(prop-1-en-2-yl)-1-benzofuran-7-carboxylic acid

4-hydroxy-5-(5-hydroxy-2-oxohexyl)oxolan-2-one

3,7-dimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),9-tetraen-11-one

(2s)-2-amino-4-[(4-oxobutyl)-c-hydroxycarbonimidoyl]butanoic acid

6-[(2z)-but-2-en-1-yl]-7-hydroxychromen-2-one

10-amino-2,7-dimethyl-11-oxo-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1,3,8(12),9-tetraen-2-ium

[C12H14N3O]+ (216.1137)

3-methyl-2-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),5(13),6,8,10-pentaene-4,7-diol

2,3,4,9-tetrahydro-pyrido-1H--(3,4b)- indole-3-carboxylic acid

{"Ingredient_id": "HBIN003866","Ingredient_name": "2,3,4,9-tetrahydro-pyrido-1H--(3,4b)- indole-3-carboxylic acid","Alias": "NA","Ingredient_formula": "C12H12N2O2","Ingredient_Smile": "C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42106","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

3,4-epoxy-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]nonane

{"Ingredient_id": "HBIN007471","Ingredient_name": "3,4-epoxy-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]nonane","Alias": "NA","Ingredient_formula": "C13H12O3","Ingredient_Smile": "NA","Ingredient_weight": "216.236","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8273","PubChem_id": "NA","DrugBank_id": "NA"}

(-)-(3S)-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid

{"Ingredient_id": "HBIN009593","Ingredient_name": "(-)-(3S)-1,2,3,4-tetrahydro-\u03b2-carboline-3-carboxylic acid","Alias": "NA","Ingredient_formula": "C12H12N2O2","Ingredient_Smile": "C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40774","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

6-(2-methoxy-z-vinyl)-7-methyl-pyranocoumarin